SCHEMBL9618669

SCHEMBL9618669

CC(C(=O)NC1CC1)S(=O)(=O)c1ccccc1Br

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
EPHX2 P34913 1/20 0.44
SMYD3 Q9H7B4 1/20 0.43
POLB P06746 1/20 0.41
KDM1A O60341 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.39
HPGD P15428 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
HTT P42858 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9849537 0.83 KMT2A (0.46) EPHX2SMYD3POLBKDM1AKMT2A
SCHEMBL9849527 0.83 ALDH1A1 (0.44) SMYD3POLBKDM1AKMT2AMEN1
SCHEMBL6965351 0.76 EPHX2 (0.55) EPHX2POLBKMT2AMEN1LMNA
SCHEMBL9849564 0.73 RAB9A (0.45) MAPTSMYD3KMT2AMEN1SMN1; SMN2
SCHEMBL15916994 0.70 MAPT (0.68) MAPTEPHX2POLBKMT2AMEN1
SCHEMBL15916996 0.70 MAPT (0.68) MAPTEPHX2POLBKMT2AMEN1
SCHEMBL4432528 0.70 CA1 (0.52) MAPTPOLBKMT2ACA1CA2
SCHEMBL29557979 0.69 CA1 (0.56) MAPTPOLBKMT2ACA1CA2
SCHEMBL1800130 0.69 CA1 (0.56) MAPTPOLBKMT2ACA1CA2
SCHEMBL15934259 0.68 MAPT (0.59) MAPTEPHX2KDM1AKMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0454459-A2 Sulfonylalkanoic acid amide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1991-10-30 EP claimed
JP-4352763-A None JP disclosed
JP-H04352763-A SULFONYLALKANOIC ACID AMIDE DERIVATIVE TAISHO PHARMACEUT CO LTD 1992-12-07 JP disclosed
EP-0454459-A2 Sulfonylalkanoic acid amide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1991-10-30 EP disclosed